4,5-bis(oxidanylidene)-3,6-bis[(3-sulfophenyl)hydrazinylidene]naphthalene-2,7-disulfonic acid

Systemtic Name: 4,5-bis(oxidanylidene)-3,6-bis[(3-sulfophenyl)hydrazinylidene]naphthalene-2,7-disulfonic acid Openeye Name: 4,5-dioxo-3,6-bis[(3-sulfophenyl)hydrazono]naphthalene-2,7-disulfonic acid CAS Name: 4,5-dioxo-3,6-bis[(3-sulfophenyl)hydrazinylidene]naphthalene-2,7-disulfonic acid IUPAC Name: 4,5-dioxo-3,6-bis[(3-sulfophenyl)hydrazinylidene]naphthalene-2,7-disulfonic acid Traditional Name: 4,5-diketo-3,6-bis[(3-sulfophenyl)hydrazono]naphthalene-2,7-disulfonic acid Formula: C22H16N4O14S4 MolecularWeight: 688.64084

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)O)NN=C2C(=CC3=C(C2=O)C(=O)C(=NNC4=CC(=CC=C4)S(=O)(=O)O)C(=C3)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)O)NN=C2C(=CC3=C(C2=O)C(=O)C(=NNC4=CC(=CC=C4)S(=O)(=O)O)C(=C3)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C22H16N4O14S4/c27-21-18-11(7-16(43(35,36)37)19(21)25-23-12-3-1-5-14(9-12)41(29,30)31)8-17(44(38,39)40)20(22(18)28)26-24-13-4-2-6-15(10-13)42(32,33)34/h1-10,23-24H,(H,29,30,31)(H,32,33,34)(H,35,36,37)(H,38,39,40)